#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmz s SER 2 N 0.00 -0.41 -0.09 1.61 0.15 -1.26 -5.16 113.70 108.54 2dmz s SER 2 Ca 0.00 -0.24 0.01 0.00 0.70 0.00 0.00 55.95 56.42 2dmz s SER 2 Cb 0.00 0.61 0.02 0.00 -1.71 0.00 0.00 66.02 64.94 2dmz s SER 2 CO 0.00 -1.05 -0.09 -0.44 1.20 0.00 0.00 173.24 172.86 2dmz s SER 3 N -2.79 1.95 -0.81 5.45 0.01 -1.26 -5.09 113.70 111.16 2dmz s SER 3 Ca 0.06 -0.29 -0.15 0.00 1.31 0.00 0.00 55.95 56.88 2dmz s SER 3 Cb -0.03 -0.81 0.19 0.00 0.21 0.00 0.00 66.02 65.58 2dmz s SER 3 CO -0.05 -0.06 0.80 -0.83 0.41 0.00 0.00 173.24 173.51 2dmz s GLY 4 N 1.26 2.47 -0.09 3.44 0.00 -1.26 -4.84 107.32 108.31 2dmz s GLY 4 Ca -0.03 -3.13 -0.11 0.00 0.00 0.00 0.00 44.72 41.44 2dmz s GLY 4 CO -0.03 1.38 0.53 1.48 0.00 0.00 0.00 173.10 176.46 2dmz h SER 5 N 8.08 0.48 -3.34 1.64 4.64 -2.00 -3.45 113.55 119.60 2dmz h SER 5 Ca 0.06 -0.91 -0.61 0.00 -0.47 0.00 0.00 61.79 59.87 2dmz h SER 5 Cb 1.04 -0.16 -0.14 0.00 -0.31 0.00 0.00 62.40 62.84 2dmz h SER 5 CO 0.84 1.76 -0.51 -0.44 -0.87 0.00 0.00 176.83 177.61 2dmz s SER 6 N -7.14 6.02 0.00 4.97 0.01 -1.26 -5.07 113.70 111.23 2dmz s SER 6 Ca -0.19 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2dmz s SER 6 Cb 0.06 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.23 2dmz s SER 6 CO 0.80 0.15 0.00 0.61 0.41 0.00 0.00 173.24 175.21 2dmz n GLY 7 N 3.70 -2.05 3.64 3.44 0.00 -1.24 -4.36 105.19 108.32 2dmz n GLY 7 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 2dmz n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dmz s GLY 8 N 0.00 -0.19 0.10 -0.02 0.00 -1.17 -4.56 107.32 101.47 2dmz s GLY 8 Ca 0.00 2.62 0.06 0.00 0.00 0.00 0.00 44.72 47.40 2dmz s GLY 8 CO 0.00 1.85 -0.14 -1.35 0.00 0.00 0.00 173.10 173.46 2dmz s SER 9 N 0.29 1.87 -0.75 1.64 1.04 -1.25 -4.73 113.70 111.81 2dmz s SER 9 Ca 0.02 -0.71 -0.11 0.00 0.48 0.00 0.00 55.95 55.63 2dmz s SER 9 Cb -0.05 -0.06 0.20 0.00 0.10 0.00 0.00 66.02 66.20 2dmz s SER 9 CO -0.06 -0.10 0.66 -1.81 0.98 0.00 0.00 173.24 172.90 2dmz s ASP 10 N -2.09 6.32 0.08 7.02 1.11 -1.26 -4.75 116.67 123.10 2dmz s ASP 10 Ca 0.04 -2.64 0.00 0.00 0.18 0.00 0.00 52.55 50.12 2dmz s ASP 10 Cb -0.07 -2.12 0.00 0.00 1.07 0.00 0.00 42.92 41.80 2dmz s ASP 10 CO 0.03 -0.55 0.00 -1.54 1.18 0.00 0.00 175.17 174.29 2dmz n SER 11 N 3.97 0.35 -3.76 0.27 3.41 -1.26 -4.90 113.62 111.71 2dmz n SER 11 Ca 0.10 0.13 -0.40 0.00 -0.26 0.00 0.00 58.87 58.44 2dmz n SER 11 Cb 0.44 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2dmz n SER 11 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dmz n SER 12 N -3.17 6.36 0.09 4.04 7.64 -1.26 -4.79 113.62 122.53 2dmz n SER 12 Ca 0.00 -3.53 0.04 0.00 1.01 0.00 0.00 58.87 56.39 2dmz n SER 12 Cb 0.17 -1.13 0.45 0.00 -1.01 0.00 0.00 64.21 62.69 2dmz n SER 12 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2dmz h LEU 13 N 4.76 0.30 -9.65 -3.43 -0.00 -1.94 -3.43 115.31 101.91 2dmz h LEU 13 Ca 0.31 -0.03 -0.56 0.00 -0.00 0.00 0.00 57.88 57.60 2dmz h LEU 13 Cb 0.51 -0.08 -0.09 0.00 -0.00 0.00 0.00 40.66 41.01 2dmz h LEU 13 CO 1.21 0.29 -0.60 -0.36 -0.00 0.00 0.00 178.44 178.98 2dmz s PHE 14 N -5.14 2.69 -0.08 1.13 0.40 -1.26 -0.95 117.98 114.76 2dmz s PHE 14 Ca -0.07 -0.30 0.02 0.00 -0.60 0.00 0.00 56.93 55.99 2dmz s PHE 14 Cb 0.17 -1.38 0.01 0.00 0.51 0.00 0.00 43.02 42.32 2dmz s PHE 14 CO 0.72 0.51 -0.15 -1.83 0.70 0.00 0.00 175.22 175.16 2dmz s GLU 15 N -3.74 2.12 -0.02 0.44 -1.05 0.53 -4.84 118.70 112.14 2dmz s GLU 15 Ca 0.34 -0.55 -0.08 0.00 -0.15 0.00 0.00 54.97 54.53 2dmz s GLU 15 Cb -0.04 -1.72 -0.05 0.00 -0.44 0.00 0.00 34.13 31.87 2dmz s GLU 15 CO 0.21 0.03 0.27 0.99 0.95 0.00 0.00 175.26 177.71 2dmz s THR 16 N 0.69 5.29 0.00 1.83 2.01 -1.26 -1.67 115.64 122.53 2dmz s THR 16 Ca -0.13 0.31 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 2dmz s THR 16 Cb -0.16 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 2dmz s THR 16 CO 0.03 0.45 0.02 -0.72 -0.69 0.00 0.00 174.62 173.72 2dmz s TYR 17 N -1.21 0.09 -0.14 4.92 1.13 -0.69 -5.00 117.35 116.44 2dmz s TYR 17 Ca 0.24 -0.18 -0.14 0.00 -1.41 0.00 0.00 57.07 55.58 2dmz s TYR 17 Cb -0.14 -0.08 -0.05 0.00 -1.10 0.00 0.00 41.96 40.60 2dmz s TYR 17 CO 0.13 -0.12 0.32 -0.80 -2.51 0.00 0.00 175.55 172.57 2dmz s ASN 18 N -0.73 6.49 -0.22 -0.18 0.01 -1.26 -3.06 114.94 116.00 2dmz s ASN 18 Ca -0.08 0.58 0.01 0.00 -0.71 0.00 0.00 52.86 52.66 2dmz s ASN 18 Cb -0.05 -2.20 0.03 0.00 0.41 0.00 0.00 41.25 39.45 2dmz s ASN 18 CO -0.00 0.12 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.87 2dmz s VAL 19 N 0.30 2.20 -0.53 1.60 1.01 -0.56 -4.91 120.40 119.51 2dmz s VAL 19 Ca 0.18 -1.20 -0.20 0.00 0.00 0.00 0.00 61.98 60.77 2dmz s VAL 19 Cb -0.13 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.22 2dmz s VAL 19 CO 0.05 0.29 0.68 -0.70 0.00 0.00 0.00 175.10 175.42 2dmz s GLU 20 N 1.23 3.12 0.29 2.72 2.12 -1.25 -0.30 118.70 126.63 2dmz s GLU 20 Ca -0.01 -0.92 -0.09 0.00 0.36 0.00 0.00 54.97 54.31 2dmz s GLU 20 Cb -0.16 -4.13 -0.07 0.00 0.26 0.00 0.00 34.13 30.03 2dmz s GLU 20 CO -0.09 -1.32 0.61 -0.51 -0.54 0.00 0.00 175.26 173.41 2dmz s LEU 21 N 2.79 4.06 -0.09 2.70 1.43 -0.04 -4.86 118.68 124.67 2dmz s LEU 21 Ca 0.16 0.94 0.02 0.00 -1.03 0.00 0.00 54.13 54.22 2dmz s LEU 21 Cb -0.20 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.26 2dmz s LEU 21 CO 0.11 -0.18 -0.15 0.54 0.23 0.00 0.00 176.35 176.90 2dmz s VAL 22 N -2.01 2.90 -0.45 -1.59 0.11 -1.26 -2.56 120.40 115.54 2dmz s VAL 22 Ca 0.48 -0.75 -0.10 0.00 -2.93 0.00 0.00 61.98 58.68 2dmz s VAL 22 Cb -0.11 -2.17 0.10 0.00 -1.53 0.00 0.00 36.38 32.67 2dmz s VAL 22 CO 0.25 0.56 0.33 -0.13 -3.33 0.00 0.00 175.10 172.77 2dmz s ARG 23 N -0.12 2.63 1.15 1.54 0.52 -1.25 -4.67 118.95 118.75 2dmz s ARG 23 Ca -0.02 -1.58 -0.17 0.00 -0.52 0.00 0.00 55.73 53.44 2dmz s ARG 23 Cb -0.14 -3.92 0.22 0.00 0.52 0.00 0.00 34.95 31.64 2dmz s ARG 23 CO 0.04 -1.09 0.46 1.63 0.02 0.00 0.00 175.30 176.36 2dmz n LYS 24 N 4.97 -2.88 -1.53 3.54 4.76 -1.26 -4.67 118.16 121.09 2dmz n LYS 24 Ca -0.10 -0.85 -0.34 0.00 -2.87 0.00 0.00 58.31 54.15 2dmz n LYS 24 Cb 0.42 -1.64 -0.07 0.00 -1.84 0.00 0.00 35.03 31.90 2dmz n LYS 24 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2dmz n ASP 25 N -2.62 2.50 0.00 4.39 5.68 -1.26 -3.15 116.55 122.09 2dmz n ASP 25 Ca 0.07 -2.65 0.00 0.00 -0.50 0.00 0.00 54.79 51.71 2dmz n ASP 25 Cb 0.45 -1.39 0.00 0.00 -1.14 0.00 0.00 41.12 39.04 2dmz n ASP 25 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dmz n GLY 26 N 5.29 3.61 3.59 6.12 0.00 -1.26 -5.10 105.19 117.43 2dmz n GLY 26 Ca 0.46 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 2dmz n GLY 26 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2dmz n GLN 27 N 0.00 1.27 -3.67 1.61 7.27 -1.19 -5.00 117.38 117.68 2dmz n GLN 27 Ca 0.00 0.45 -0.22 0.00 0.07 0.00 0.00 57.00 57.30 2dmz n GLN 27 Cb 0.00 -1.92 -0.03 0.00 2.41 0.00 0.00 30.24 30.70 2dmz n GLN 27 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2dmz s SER 28 N -0.70 4.92 0.03 1.69 0.01 -1.26 -4.22 113.70 114.17 2dmz s SER 28 Ca 0.62 -0.84 -0.08 0.00 1.31 0.00 0.00 55.95 56.95 2dmz s SER 28 Cb -0.61 -0.47 -0.03 0.00 0.21 0.00 0.00 66.02 65.12 2dmz s SER 28 CO 0.58 -0.68 1.13 0.25 0.41 0.00 0.00 173.24 174.93 2dmz h LEU 29 N 1.05 -0.39 -2.40 2.44 5.85 -1.94 -3.25 115.31 116.68 2dmz h LEU 29 Ca -0.41 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2dmz h LEU 29 Cb 1.27 0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2dmz h LEU 29 CO 0.59 -0.13 0.00 0.61 -0.34 0.00 0.00 178.44 179.17 2dmz n GLY 30 N -1.11 0.67 2.78 3.75 0.00 -1.26 -2.88 105.19 107.13 2dmz n GLY 30 Ca -0.02 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 2dmz n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dmz s ILE 31 N -2.95 0.58 0.24 -0.61 1.01 -1.26 -2.48 121.20 115.73 2dmz s ILE 31 Ca 0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 60.65 60.12 2dmz s ILE 31 Cb 0.00 -0.89 -0.09 0.00 0.01 0.00 0.00 42.46 41.50 2dmz s ILE 31 CO 0.00 0.04 0.79 -0.13 0.00 0.00 0.00 174.94 175.64 2dmz s ARG 32 N 1.86 4.40 0.34 2.79 1.81 -0.01 -5.01 118.95 125.13 2dmz s ARG 32 Ca 0.02 1.04 0.04 0.00 -1.72 0.00 0.00 55.73 55.11 2dmz s ARG 32 Cb -0.15 -2.94 -0.07 0.00 -0.45 0.00 0.00 34.95 31.35 2dmz s ARG 32 CO -0.07 0.40 0.05 0.96 -0.68 0.00 0.00 175.30 175.96 2dmz s ILE 33 N -1.47 1.37 -0.06 1.52 -4.36 -1.26 -1.71 121.20 115.22 2dmz s ILE 33 Ca 0.43 -2.00 -0.19 0.00 -0.26 0.00 0.00 60.65 58.63 2dmz s ILE 33 Cb -0.18 -2.84 0.04 0.00 1.25 0.00 0.00 42.46 40.73 2dmz s ILE 33 CO 0.23 -0.00 0.43 0.54 0.24 0.00 0.00 174.94 176.38 2dmz s VAL 34 N -3.17 0.03 -0.50 8.37 0.11 -0.49 -4.53 120.40 120.21 2dmz s VAL 34 Ca 0.36 -0.24 -0.17 0.00 -2.93 0.00 0.00 61.98 59.00 2dmz s VAL 34 Cb 0.09 -0.71 0.08 0.00 -1.53 0.00 0.00 36.38 34.31 2dmz s VAL 34 CO 0.16 -0.13 0.51 -0.83 -3.33 0.00 0.00 175.10 171.48 2dmz s GLY 35 N -0.90 1.93 0.23 6.54 0.00 -1.26 -2.18 107.32 111.68 2dmz s GLY 35 Ca -0.10 -2.04 -0.20 0.00 0.00 0.00 0.00 44.72 42.38 2dmz s GLY 35 CO 0.05 1.26 0.74 -0.19 0.00 0.00 0.00 173.10 174.96 2dmz s TYR 36 N 2.07 3.67 -0.04 1.90 1.51 0.09 -4.95 117.35 121.60 2dmz s TYR 36 Ca 0.08 1.43 0.01 0.00 -1.01 0.00 0.00 57.07 57.59 2dmz s TYR 36 Cb -0.23 -2.65 -0.03 0.00 -0.11 0.00 0.00 41.96 38.93 2dmz s TYR 36 CO 0.08 0.34 -0.02 0.28 -1.11 0.00 0.00 175.55 175.12 2dmz n VAL 37 N 0.77 0.25 0.00 0.71 0.31 -1.26 -2.48 118.33 116.62 2dmz n VAL 37 Ca -0.02 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 2dmz n VAL 37 Cb 0.51 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.69 2dmz n VAL 37 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dmz n GLY 38 N 3.12 -2.15 2.52 2.92 0.00 -1.23 -4.73 105.19 105.64 2dmz n GLY 38 Ca -0.07 -1.45 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 2dmz n GLY 38 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dmz n THR 39 N -1.43 2.85 -3.72 2.61 5.66 -1.26 -5.00 114.28 113.99 2dmz n THR 39 Ca 0.00 -4.47 -0.02 0.00 -3.05 0.00 0.00 64.05 56.51 2dmz n THR 39 Cb 0.00 -1.23 -0.01 0.00 -1.55 0.00 0.00 70.33 67.54 2dmz n THR 39 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2dmz s SER 40 N -2.71 -0.15 -0.12 1.09 0.01 -1.26 -5.06 113.70 105.50 2dmz s SER 40 Ca 0.51 -0.33 0.06 0.00 1.31 0.00 0.00 55.95 57.51 2dmz s SER 40 Cb 0.42 0.40 -0.24 0.00 0.21 0.00 0.00 66.02 66.82 2dmz s SER 40 CO -0.20 -0.74 0.35 0.00 0.41 0.00 0.00 173.24 173.07 2dmz n HIS 41 N -0.47 0.77 -4.35 2.43 1.44 -1.26 -4.93 115.22 108.85 2dmz n HIS 41 Ca -0.07 0.22 -0.18 0.00 -2.01 0.00 0.00 57.72 55.69 2dmz n HIS 41 Cb 0.61 -1.12 -0.10 0.00 0.12 0.00 0.00 29.99 29.50 2dmz n HIS 41 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2dmz s THR 42 N -2.56 1.28 -0.92 0.61 -4.23 -1.26 -4.90 115.64 103.67 2dmz s THR 42 Ca -0.15 -2.08 -0.09 0.00 -1.18 0.00 0.00 61.69 58.20 2dmz s THR 42 Cb 0.07 -2.27 0.01 0.00 1.34 0.00 0.00 72.50 71.65 2dmz s THR 42 CO 0.78 -0.41 0.66 0.61 -0.54 0.00 0.00 174.62 175.72 2dmz n GLY 43 N -0.43 -1.18 3.39 3.99 0.00 -1.26 -4.99 105.19 104.71 2dmz n GLY 43 Ca -0.06 0.52 -0.13 0.00 0.00 0.00 0.00 46.02 46.34 2dmz n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dmz s GLU 44 N -5.22 1.06 -0.22 1.61 2.56 -1.26 -5.00 118.70 112.23 2dmz s GLU 44 Ca 0.15 -0.30 -0.27 0.00 0.00 0.00 0.00 54.97 54.55 2dmz s GLU 44 Cb -0.07 0.48 0.00 0.00 2.00 0.00 0.00 34.13 36.54 2dmz s GLU 44 CO 0.88 -0.40 0.93 0.00 -0.56 0.00 0.00 175.26 176.12 2dmz s ALA 45 N -2.70 3.64 -0.12 6.30 0.00 -1.26 -5.02 121.76 122.60 2dmz s ALA 45 Ca -0.04 0.05 -0.05 0.00 0.00 0.00 0.00 51.96 51.92 2dmz s ALA 45 Cb -0.00 -3.41 0.06 0.00 0.00 0.00 0.00 23.12 19.77 2dmz s ALA 45 CO -0.04 -0.94 0.25 -1.54 0.00 0.00 0.00 175.76 173.49 2dmz s SER 46 N 1.25 0.25 0.00 0.00 1.04 -1.26 -3.50 113.70 111.47 2dmz s SER 46 Ca 0.40 0.55 0.00 0.00 0.48 0.00 0.00 55.95 57.38 2dmz s SER 46 Cb -0.15 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2dmz s SER 46 CO 0.08 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2dmz n GLY 47 N 5.09 -0.04 3.08 7.32 0.00 -1.04 -4.97 105.19 114.63 2dmz n GLY 47 Ca -0.10 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 2dmz n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dmz s ILE 48 N -0.75 1.70 0.07 -0.61 -1.09 -1.26 -0.73 121.20 118.53 2dmz s ILE 48 Ca 0.00 -0.75 0.07 0.00 -2.23 0.00 0.00 60.65 57.74 2dmz s ILE 48 Cb 0.00 -1.54 -0.03 0.00 -1.58 0.00 0.00 42.46 39.31 2dmz s ILE 48 CO 0.00 0.48 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.69 2dmz s TYR 49 N 1.08 1.62 -0.32 3.97 1.51 -0.93 -2.74 117.35 121.54 2dmz s TYR 49 Ca -0.03 -0.40 -0.28 0.00 -1.01 0.00 0.00 57.07 55.35 2dmz s TYR 49 Cb -0.14 -0.93 -0.02 0.00 -0.11 0.00 0.00 41.96 40.75 2dmz s TYR 49 CO -0.05 0.12 1.86 0.08 -1.11 0.00 0.00 175.55 176.45 2dmz s VAL 50 N -1.00 3.41 0.12 0.71 1.01 -0.99 -1.40 120.40 122.25 2dmz s VAL 50 Ca 0.05 0.42 -0.10 0.00 0.00 0.00 0.00 61.98 62.34 2dmz s VAL 50 Cb -0.09 -3.57 -0.16 0.00 0.00 0.00 0.00 36.38 32.56 2dmz s VAL 50 CO 0.03 -0.37 1.32 0.50 0.00 0.00 0.00 175.10 176.58 2dmz h LYS 51 N 13.23 0.68 -2.54 2.72 1.63 -1.57 -3.27 116.57 127.45 2dmz h LYS 51 Ca -0.34 -0.59 0.12 0.00 -0.85 0.00 0.00 60.65 58.99 2dmz h LYS 51 Cb 1.18 0.13 -0.09 0.00 -0.60 0.00 0.00 32.23 32.85 2dmz h LYS 51 CO 1.03 1.20 0.40 -1.12 -3.45 0.00 0.00 179.45 177.51 2dmz s SER 52 N -7.10 -0.26 -0.17 4.20 0.01 -1.24 -4.86 113.70 104.26 2dmz s SER 52 Ca -0.09 -0.35 -0.02 0.00 1.31 0.00 0.00 55.95 56.80 2dmz s SER 52 Cb 0.09 0.54 0.05 0.00 0.21 0.00 0.00 66.02 66.91 2dmz s SER 52 CO 0.89 -0.96 0.02 -0.69 0.41 0.00 0.00 173.24 172.91 2dmz s VAL 53 N -3.44 0.60 0.14 3.43 1.01 -1.26 -0.83 120.40 120.05 2dmz s VAL 53 Ca 0.10 -0.48 -0.32 0.00 0.00 0.00 0.00 61.98 61.28 2dmz s VAL 53 Cb -0.02 -1.01 -0.12 0.00 0.00 0.00 0.00 36.38 35.23 2dmz s VAL 53 CO 0.00 -0.09 1.77 -0.38 0.00 0.00 0.00 175.10 176.40 2dmz n ILE 54 N 5.03 0.21 -1.96 2.22 -0.00 -1.03 -4.91 119.36 118.92 2dmz n ILE 54 Ca -0.09 -0.04 -0.34 0.00 -0.00 0.00 0.00 62.75 62.28 2dmz n ILE 54 Cb 0.48 -1.97 0.03 0.00 -0.00 0.00 0.00 39.64 38.17 2dmz n ILE 54 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2dmz s PRO 55 N 2.07 3.03 -1.16 0.38 0.04 -1.26 -3.47 135.00 134.62 2dmz s PRO 55 Ca 0.80 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2dmz s PRO 55 Cb -0.53 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.03 2dmz s PRO 55 CO 0.37 -1.09 0.00 0.41 0.04 0.00 0.00 177.00 176.73 2dmz n GLY 56 N -0.24 0.67 2.34 0.56 0.00 -1.26 -5.01 105.19 102.25 2dmz n GLY 56 Ca 0.11 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.51 2dmz n GLY 56 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dmz n SER 57 N -0.09 2.49 0.03 1.61 3.41 -1.23 -4.96 113.62 114.88 2dmz n SER 57 Ca -0.13 -2.29 -0.13 0.00 -0.26 0.00 0.00 58.87 56.06 2dmz n SER 57 Cb 0.49 0.10 -0.09 0.00 -0.26 0.00 0.00 64.21 64.45 2dmz n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dmz h ALA 58 N 0.93 -0.07 0.15 7.33 0.00 -1.57 -0.56 119.26 125.47 2dmz h ALA 58 Ca -0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2dmz h ALA 58 Cb 0.80 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2dmz h ALA 58 CO 0.39 -0.38 -0.07 0.00 0.00 0.00 0.00 179.25 179.19 2dmz h ALA 59 N 0.54 -0.21 -0.56 0.00 0.00 -1.81 -0.60 119.26 116.62 2dmz h ALA 59 Ca -0.01 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2dmz h ALA 59 Cb 0.35 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2dmz h ALA 59 CO 0.01 -0.60 0.32 -0.92 0.00 0.00 0.00 179.25 178.06 2dmz h TYR 60 N -0.24 0.59 -0.33 0.00 3.20 -1.74 -1.97 116.97 116.49 2dmz h TYR 60 Ca -0.02 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dmz h TYR 60 Cb 0.18 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2dmz h TYR 60 CO -0.06 0.32 0.21 0.45 -1.64 0.00 0.00 178.16 177.44 2dmz h HIS 61 N 0.62 0.42 0.29 -3.82 3.86 -0.91 -3.08 115.15 112.53 2dmz h HIS 61 Ca 0.24 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2dmz h HIS 61 Cb 0.08 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 2dmz h HIS 61 CO -0.08 0.27 -0.39 -0.97 0.86 0.00 0.00 177.93 177.63 2dmz h ASN 62 N 0.44 -1.08 -0.09 2.45 -1.24 -0.67 -3.47 115.58 111.92 2dmz h ASN 62 Ca 0.12 0.10 0.00 0.00 0.71 0.00 0.00 56.30 57.23 2dmz h ASN 62 Cb -0.04 0.38 0.00 0.00 0.73 0.00 0.00 38.32 39.39 2dmz h ASN 62 CO -0.03 -0.51 0.00 0.61 -1.29 0.00 0.00 177.43 176.22 2dmz n GLY 63 N -1.47 0.84 0.00 1.57 0.00 -0.78 -4.96 105.19 100.39 2dmz n GLY 63 Ca -0.09 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2dmz n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dmz n HIS 64 N -2.99 0.00 -3.90 1.61 8.25 -1.26 -4.98 115.22 111.95 2dmz n HIS 64 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 2dmz n HIS 64 Cb 0.36 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.33 2dmz n HIS 64 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2dmz s ILE 65 N -1.89 2.99 0.30 1.59 1.01 -1.26 -5.08 121.20 118.86 2dmz s ILE 65 Ca 0.00 -1.45 0.02 0.00 0.00 0.00 0.00 60.65 59.22 2dmz s ILE 65 Cb 0.00 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.71 2dmz s ILE 65 CO 0.00 -0.16 0.35 0.00 0.00 0.00 0.00 174.94 175.13 2dmz n GLN 66 N 4.61 0.50 -0.83 2.79 0.00 -1.26 -4.69 117.38 118.51 2dmz n GLN 66 Ca -0.12 -2.60 -0.34 0.00 0.00 0.00 0.00 57.00 53.94 2dmz n GLN 66 Cb 0.43 2.34 0.11 0.00 0.00 0.00 0.00 30.24 33.12 2dmz n GLN 66 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2dmz n VAL 67 N -0.52 0.00 -3.15 -0.39 0.24 -1.26 -3.39 118.33 109.87 2dmz n VAL 67 Ca 0.03 -0.27 -0.18 0.00 -2.04 0.00 0.00 64.34 61.89 2dmz n VAL 67 Cb 0.51 -0.44 0.05 0.00 -1.47 0.00 0.00 33.84 32.49 2dmz n VAL 67 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2dmz n ASN 68 N 0.02 -5.27 -4.09 -1.34 3.02 -1.23 -4.94 115.26 101.43 2dmz n ASN 68 Ca 0.03 -0.34 -0.17 0.00 -0.03 0.00 0.00 54.58 54.07 2dmz n ASN 68 Cb 0.57 -3.97 -0.13 0.00 -0.61 0.00 0.00 39.78 35.65 2dmz n ASN 68 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2dmz s ASP 69 N -3.07 1.25 -0.21 6.41 1.01 -1.22 -5.01 116.67 115.85 2dmz s ASP 69 Ca 0.37 -0.46 -0.02 0.00 0.71 0.00 0.00 52.55 53.15 2dmz s ASP 69 Cb -0.16 -0.05 0.00 0.00 1.01 0.00 0.00 42.92 43.73 2dmz s ASP 69 CO 0.46 -0.06 -0.10 -0.75 0.21 0.00 0.00 175.17 174.93 2dmz s LYS 70 N -1.23 3.20 -0.18 8.23 2.20 -1.26 -2.35 119.74 128.35 2dmz s LYS 70 Ca -0.03 -0.72 -0.18 0.00 -0.36 0.00 0.00 55.97 54.69 2dmz s LYS 70 Cb -0.08 -2.85 -0.04 0.00 -1.51 0.00 0.00 37.83 33.36 2dmz s LYS 70 CO 0.01 -0.21 0.47 0.42 -0.36 0.00 0.00 175.35 175.68 2dmz s ILE 71 N 1.40 5.16 -0.12 5.43 1.09 -1.11 -2.26 121.20 130.79 2dmz s ILE 71 Ca 0.05 0.88 0.16 0.00 -1.10 0.00 0.00 60.65 60.64 2dmz s ILE 71 Cb -0.14 -3.80 -0.23 0.00 -1.06 0.00 0.00 42.46 37.23 2dmz s ILE 71 CO -0.07 0.24 0.16 1.33 -0.10 0.00 0.00 174.94 176.51 2dmz n VAL 72 N 4.24 0.80 -3.68 2.92 0.24 0.69 -4.67 118.33 118.87 2dmz n VAL 72 Ca -0.06 -0.62 -0.14 0.00 -2.04 0.00 0.00 64.34 61.48 2dmz n VAL 72 Cb 0.51 -0.35 -0.08 0.00 -1.47 0.00 0.00 33.84 32.44 2dmz n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dmz s ALA 73 N -2.67 -1.42 -0.26 2.33 0.00 -1.10 -2.20 121.76 116.44 2dmz s ALA 73 Ca -0.08 1.62 -0.05 0.00 0.00 0.00 0.00 51.96 53.46 2dmz s ALA 73 Cb 0.07 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.25 2dmz s ALA 73 CO 0.71 -0.27 0.01 0.08 0.00 0.00 0.00 175.76 176.29 2dmz s VAL 74 N 0.32 3.56 -1.22 0.00 1.01 0.83 0.70 120.40 125.59 2dmz s VAL 74 Ca -0.00 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2dmz s VAL 74 Cb -0.04 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2dmz s VAL 74 CO 0.01 0.21 0.00 -0.90 0.00 0.00 0.00 175.10 174.42 2dmz n ASP 75 N 4.80 -4.01 0.00 3.32 5.68 0.44 0.23 116.55 127.01 2dmz n ASP 75 Ca -0.16 0.21 0.00 0.00 -0.50 0.00 0.00 54.79 54.34 2dmz n ASP 75 Cb 0.49 -3.47 0.00 0.00 -1.14 0.00 0.00 41.12 36.99 2dmz n ASP 75 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dmz n GLY 76 N -0.68 2.92 3.59 6.12 0.00 -1.25 -4.80 105.19 111.10 2dmz n GLY 76 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2dmz n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dmz s VAL 77 N -2.64 3.76 -0.92 1.61 1.01 0.13 -4.91 120.40 118.44 2dmz s VAL 77 Ca 0.00 0.74 -0.25 0.00 0.00 0.00 0.00 61.98 62.47 2dmz s VAL 77 Cb 0.00 -4.13 -0.10 0.00 0.00 0.00 0.00 36.38 32.16 2dmz s VAL 77 CO 0.00 -0.78 2.10 0.21 0.00 0.00 0.00 175.10 176.63 2dmz s ASN 78 N 4.70 4.60 -0.10 3.32 2.47 -1.26 -0.12 114.94 128.55 2dmz s ASN 78 Ca 0.63 -0.61 0.02 0.00 0.42 0.00 0.00 52.86 53.32 2dmz s ASN 78 Cb -0.15 -2.56 0.20 0.00 -1.45 0.00 0.00 41.25 37.29 2dmz s ASN 78 CO 0.31 -3.31 1.08 2.30 -3.72 0.00 0.00 177.10 173.76 2dmz n ILE 79 N 8.24 1.25 -0.77 -5.21 -5.35 -0.93 -4.60 119.36 111.99 2dmz n ILE 79 Ca 0.43 -0.46 -0.12 0.00 -0.27 0.00 0.00 62.75 62.33 2dmz n ILE 79 Cb 0.46 -0.69 -0.11 0.00 -1.74 0.00 0.00 39.64 37.55 2dmz n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dmz n GLN 80 N 0.10 1.65 0.00 6.28 6.02 -1.10 -2.93 117.38 127.40 2dmz n GLN 80 Ca 0.13 -0.88 0.00 0.00 -0.01 0.00 0.00 57.00 56.24 2dmz n GLN 80 Cb 0.69 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.98 2dmz n GLN 80 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dmz n GLY 81 N 2.77 0.00 3.86 1.08 0.00 -1.26 -5.17 105.19 106.48 2dmz n GLY 81 Ca 0.35 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.16 2dmz n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dmz s PHE 82 N 0.00 3.15 0.27 1.61 0.40 -1.15 -5.10 117.98 117.16 2dmz s PHE 82 Ca 0.00 -0.12 -0.24 0.00 -0.60 0.00 0.00 56.93 55.97 2dmz s PHE 82 Cb 0.00 -1.51 -0.09 0.00 0.51 0.00 0.00 43.02 41.93 2dmz s PHE 82 CO 0.00 0.44 0.85 0.00 0.70 0.00 0.00 175.22 177.21 2dmz s ALA 83 N -2.13 3.31 0.09 5.36 0.00 -1.26 -4.83 121.76 122.30 2dmz s ALA 83 Ca 0.35 0.38 -0.18 0.00 0.00 0.00 0.00 51.96 52.51 2dmz s ALA 83 Cb -0.08 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 2dmz s ALA 83 CO 0.26 0.24 1.00 0.09 0.00 0.00 0.00 175.76 177.35 2dmz n ASN 84 N 0.73 -0.61 -0.33 0.00 4.13 -1.26 0.15 115.26 118.07 2dmz n ASN 84 Ca -0.00 1.13 -0.04 0.00 1.68 0.00 0.00 54.58 57.35 2dmz n ASN 84 Cb 0.50 -0.19 0.09 0.00 -1.54 0.00 0.00 39.78 38.64 2dmz n ASN 84 CO 0.00 0.00 0.00 1.12 0.28 0.00 0.00 177.26 178.66 2dmz h HIS 85 N 0.00 1.23 -0.40 3.10 2.07 -2.00 -1.95 115.15 117.21 2dmz h HIS 85 Ca 0.09 -0.04 0.08 0.00 -2.85 0.00 0.00 60.37 57.65 2dmz h HIS 85 Cb 0.24 -0.39 -0.02 0.00 2.57 0.00 0.00 27.41 29.80 2dmz h HIS 85 CO -0.70 0.86 0.27 -0.44 -3.07 0.00 0.00 177.93 174.86 2dmz h ASP 86 N 1.25 0.18 0.86 3.10 3.32 0.11 -0.61 116.42 124.62 2dmz h ASP 86 Ca 0.31 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.15 2dmz h ASP 86 Cb 0.06 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2dmz h ASP 86 CO -0.05 0.11 -0.98 0.58 -1.72 0.00 0.00 179.24 177.18 2dmz h VAL 87 N 0.20 1.63 -0.00 -1.35 2.07 0.27 -3.25 116.25 115.82 2dmz h VAL 87 Ca 0.18 -3.15 0.00 0.00 0.82 0.00 0.00 66.70 64.55 2dmz h VAL 87 Cb 0.47 2.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2dmz h VAL 87 CO -0.03 0.90 0.00 0.58 0.02 0.00 0.00 177.57 179.05 2dmz h VAL 88 N 0.02 1.02 -0.47 2.57 2.07 -0.68 -2.43 116.25 118.35 2dmz h VAL 88 Ca -0.03 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2dmz h VAL 88 Cb 1.70 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 2dmz h VAL 88 CO 0.14 0.01 0.31 1.05 0.02 0.00 0.00 177.57 179.10 2dmz h GLU 89 N -0.01 0.56 -0.66 1.57 4.11 -1.59 -2.08 114.58 116.46 2dmz h GLU 89 Ca 0.00 -0.03 0.02 0.00 0.07 0.00 0.00 59.36 59.41 2dmz h GLU 89 Cb 0.02 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 2dmz h GLU 89 CO -0.00 0.37 0.43 0.28 0.07 0.00 0.00 179.01 180.16 2dmz h VAL 90 N 0.57 1.14 -0.22 -1.06 2.07 -1.47 0.03 116.25 117.31 2dmz h VAL 90 Ca 0.18 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2dmz h VAL 90 Cb 0.03 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 2dmz h VAL 90 CO -0.04 0.16 0.06 -0.07 0.02 0.00 0.00 177.57 177.70 2dmz h LEU 91 N 0.87 0.33 -0.86 2.57 3.38 -1.12 -2.15 115.31 118.32 2dmz h LEU 91 Ca 0.25 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2dmz h LEU 91 Cb -0.06 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2dmz h LEU 91 CO -0.07 0.46 0.51 0.03 0.09 0.00 0.00 178.44 179.45 2dmz h ARG 92 N 0.18 1.17 -0.66 1.13 3.08 -1.21 -2.33 114.38 115.75 2dmz h ARG 92 Ca 0.07 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2dmz h ARG 92 Cb 0.25 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 2dmz h ARG 92 CO -0.00 0.83 0.31 -0.91 -1.07 0.00 0.00 179.97 179.13 2dmz h ASN 93 N 1.18 0.84 -3.48 7.04 2.35 -0.83 -3.43 115.58 119.24 2dmz h ASN 93 Ca 0.31 -0.09 -0.57 0.00 -0.55 0.00 0.00 56.30 55.40 2dmz h ASN 93 Cb -0.03 -0.22 0.15 0.00 0.05 0.00 0.00 38.32 38.27 2dmz h ASN 93 CO -0.06 0.72 0.16 0.00 -1.65 0.00 0.00 177.43 176.60 2dmz n ALA 94 N -2.44 0.26 -1.80 -0.83 0.00 -0.82 -5.02 120.51 109.85 2dmz n ALA 94 Ca 0.06 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2dmz n ALA 94 Cb 0.13 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.47 2dmz n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dmz n GLY 95 N 1.24 1.55 0.45 0.00 0.00 -1.26 -5.01 105.19 102.16 2dmz n GLY 95 Ca 0.12 -1.89 -0.16 0.00 0.00 0.00 0.00 46.02 44.09 2dmz n GLY 95 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2dmz h GLN 96 N 0.00 -0.84 -6.04 1.61 4.15 -1.91 -3.36 115.11 108.72 2dmz h GLN 96 Ca 0.00 0.06 -0.50 0.00 0.77 0.00 0.00 58.65 58.98 2dmz h GLN 96 Cb 0.00 0.19 -0.04 0.00 0.21 0.00 0.00 27.48 27.84 2dmz h GLN 96 CO 0.00 -0.56 1.27 0.08 -1.93 0.00 0.00 178.83 177.69 2dmz s VAL 97 N -5.56 3.43 -0.37 2.39 1.01 -1.26 -3.80 120.40 116.23 2dmz s VAL 97 Ca -0.16 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 2dmz s VAL 97 Cb 0.04 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.35 2dmz s VAL 97 CO 0.55 -1.11 0.16 -0.69 0.00 0.00 0.00 175.10 174.01 2dmz s VAL 98 N 8.43 3.65 -0.73 2.92 1.01 -1.06 -4.93 120.40 129.70 2dmz s VAL 98 Ca 0.61 -1.50 -0.20 0.00 0.00 0.00 0.00 61.98 60.89 2dmz s VAL 98 Cb -0.11 -3.24 0.11 0.00 0.00 0.00 0.00 36.38 33.14 2dmz s VAL 98 CO 0.18 -0.40 0.90 -1.00 0.00 0.00 0.00 175.10 174.79 2dmz s HIS 99 N 1.32 3.00 0.05 5.22 3.76 -1.24 -0.86 115.29 126.53 2dmz s HIS 99 Ca 0.02 -1.05 -0.30 0.00 -0.15 0.00 0.00 55.06 53.58 2dmz s HIS 99 Cb -0.22 -4.16 -0.04 0.00 1.11 0.00 0.00 32.58 29.28 2dmz s HIS 99 CO 0.00 -1.43 0.99 -1.17 -0.85 0.00 0.00 174.74 172.28 2dmz s LEU 100 N 2.89 4.42 -0.45 0.89 1.98 0.59 0.17 118.68 129.17 2dmz s LEU 100 Ca 0.21 1.74 -0.10 0.00 -2.89 0.00 0.00 54.13 53.09 2dmz s LEU 100 Cb -0.16 -3.58 0.09 0.00 0.66 0.00 0.00 46.19 43.21 2dmz s LEU 100 CO 0.02 -0.19 0.31 -0.89 -1.89 0.00 0.00 176.35 173.71 2dmz s THR 101 N 0.59 4.36 0.30 3.68 2.01 0.22 -1.50 115.64 125.30 2dmz s THR 101 Ca 0.50 -1.51 0.11 0.00 0.31 0.00 0.00 61.69 61.10 2dmz s THR 101 Cb -0.22 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 2dmz s THR 101 CO 0.29 -0.62 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.71 2dmz s LEU 102 N 1.43 2.76 -0.05 4.42 1.02 -1.17 -0.22 118.68 126.86 2dmz s LEU 102 Ca 0.04 -0.99 -0.01 0.00 0.02 0.00 0.00 54.13 53.18 2dmz s LEU 102 Cb -0.25 -1.21 0.03 0.00 0.02 0.00 0.00 46.19 44.78 2dmz s LEU 102 CO 0.02 -0.04 0.03 0.54 0.02 0.00 0.00 176.35 176.91 2dmz s VAL 103 N -2.50 0.15 0.19 -1.59 0.11 -0.96 -1.71 120.40 114.09 2dmz s VAL 103 Ca 0.31 0.24 0.07 0.00 -2.93 0.00 0.00 61.98 59.68 2dmz s VAL 103 Cb -0.03 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2dmz s VAL 103 CO 0.17 0.21 0.04 0.00 -3.33 0.00 0.00 175.10 172.19 2dmz s ARG 104 N 1.93 2.54 -0.01 1.54 1.70 -0.67 -4.36 118.95 121.61 2dmz s ARG 104 Ca 0.03 -1.08 -0.30 0.00 -0.47 0.00 0.00 55.73 53.91 2dmz s ARG 104 Cb -0.12 -2.42 -0.04 0.00 -0.57 0.00 0.00 34.95 31.80 2dmz s ARG 104 CO -0.04 0.45 1.18 0.50 -1.08 0.00 0.00 175.30 176.31 2dmz s ARG 105 N -3.11 4.40 -0.09 3.89 3.52 -1.26 -0.35 118.95 125.95 2dmz s ARG 105 Ca 0.29 1.68 -0.00 0.00 -0.13 0.00 0.00 55.73 57.57 2dmz s ARG 105 Cb -0.09 -3.48 -0.00 0.00 -1.56 0.00 0.00 34.95 29.82 2dmz s ARG 105 CO 0.20 -0.35 -0.01 0.87 -0.81 0.00 0.00 175.30 175.21 2dmz h LYS 106 N 7.19 0.00 -4.04 5.12 1.57 -1.37 -3.47 116.57 121.57 2dmz h LYS 106 Ca -0.37 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 57.99 2dmz h LYS 106 Cb 1.18 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.60 2dmz h LYS 106 CO 0.85 0.00 -0.68 0.25 -0.57 0.00 0.00 179.45 179.29 2dmz n THR 107 N -4.54 0.30 -0.61 -0.16 -2.24 -1.24 -4.90 114.28 100.88 2dmz n THR 107 Ca -0.00 -0.34 -0.23 0.00 -2.27 0.00 0.00 64.05 61.21 2dmz n THR 107 Cb 0.01 0.00 0.20 0.00 -2.10 0.00 0.00 70.33 68.44 2dmz n THR 107 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2dmz n SER 108 N 1.61 -2.59 -1.80 3.42 2.88 -1.26 -4.82 113.62 111.06 2dmz n SER 108 Ca 0.07 -0.87 -0.06 0.00 -1.33 0.00 0.00 58.87 56.68 2dmz n SER 108 Cb 0.28 -0.76 -0.09 0.00 -0.75 0.00 0.00 64.21 62.89 2dmz n SER 108 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dmz n SER 109 N -4.73 5.04 -0.82 -3.46 2.88 -1.26 -4.52 113.62 106.75 2dmz n SER 109 Ca 0.11 -2.39 -0.08 0.00 -1.33 0.00 0.00 58.87 55.17 2dmz n SER 109 Cb 0.45 -1.23 -0.02 0.00 -0.75 0.00 0.00 64.21 62.66 2dmz n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dmz n SER 110 N 2.08 -3.37 -0.34 -3.46 2.88 -1.26 -4.90 113.62 105.26 2dmz n SER 110 Ca 0.23 0.08 0.09 0.00 -1.33 0.00 0.00 58.87 57.93 2dmz n SER 110 Cb 0.70 -2.24 -0.02 0.00 -0.75 0.00 0.00 64.21 61.90 2dmz n SER 110 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2dmz n THR 111 N -3.51 0.00 -2.64 2.46 -2.24 -1.26 -4.98 114.28 102.10 2dmz n THR 111 Ca -0.09 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.10 2dmz n THR 111 Cb 0.45 1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 69.82 2dmz n THR 111 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2dmz s SER 112 N -2.16 6.63 0.38 3.42 0.01 -1.26 -5.08 113.70 115.64 2dmz s SER 112 Ca 0.13 1.42 0.00 0.00 1.31 0.00 0.00 55.95 58.81 2dmz s SER 112 Cb 0.14 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.93 2dmz s SER 112 CO 0.50 -0.47 0.00 -0.81 0.41 0.00 0.00 173.24 172.86 2dmz n PRO 113 N -1.30 0.23 0.09 12.44 -0.04 -1.26 -4.96 135.00 140.19 2dmz n PRO 113 Ca 0.05 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.39 2dmz n PRO 113 Cb 0.54 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.93 2dmz n PRO 113 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2dmz h LEU 114 N 0.00 0.33 -6.27 1.53 -0.00 -2.03 -3.39 115.31 105.49 2dmz h LEU 114 Ca 0.00 -0.30 -0.58 0.00 -0.00 0.00 0.00 57.88 56.99 2dmz h LEU 114 Cb 0.00 -0.10 -0.39 0.00 -0.00 0.00 0.00 40.66 40.16 2dmz h LEU 114 CO 0.00 1.16 -0.93 -0.62 -0.00 0.00 0.00 178.44 178.05 2dmz n GLU 115 N -3.59 0.93 -2.12 0.17 1.02 -1.26 -5.10 120.64 110.69 2dmz n GLU 115 Ca -0.05 -3.56 -0.43 0.00 -0.02 0.00 0.00 57.16 53.10 2dmz n GLU 115 Cb 0.90 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 30.66 2dmz n GLU 115 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2dmz s PRO 116 N -1.00 3.87 -1.05 3.49 0.04 -1.26 -4.92 135.00 134.17 2dmz s PRO 116 Ca 0.34 1.72 -0.24 0.00 0.04 0.00 0.00 61.00 62.86 2dmz s PRO 116 Cb 0.10 -4.01 -0.07 0.00 0.04 0.00 0.00 34.50 30.56 2dmz s PRO 116 CO -0.13 -1.20 1.94 -1.25 0.04 0.00 0.00 177.00 176.40 2dmz s PRO 117 N 4.52 2.53 0.01 0.56 0.04 -1.26 -4.57 135.00 136.82 2dmz s PRO 117 Ca 0.70 -0.74 -0.03 0.00 0.04 0.00 0.00 61.00 60.97 2dmz s PRO 117 Cb -0.26 -5.16 -0.01 0.00 0.04 0.00 0.00 34.50 29.12 2dmz s PRO 117 CO 0.28 -3.69 -0.06 0.43 0.04 0.00 0.00 177.00 174.00 2dmz n SER 118 N 14.18 0.85 -4.85 6.66 7.64 -1.26 -5.07 113.62 131.76 2dmz n SER 118 Ca 0.43 0.12 -0.24 0.00 1.01 0.00 0.00 58.87 60.18 2dmz n SER 118 Cb 0.47 -0.34 -0.04 0.00 -1.01 0.00 0.00 64.21 63.29 2dmz n SER 118 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dmz s ASP 119 N -5.51 5.76 -0.88 6.43 2.15 -1.26 -5.07 116.67 118.28 2dmz s ASP 119 Ca -0.05 -0.09 -0.12 0.00 0.43 0.00 0.00 52.55 52.72 2dmz s ASP 119 Cb 0.01 -1.56 0.23 0.00 -0.30 0.00 0.00 42.92 41.30 2dmz s ASP 119 CO 0.08 0.02 0.83 -0.60 -0.17 0.00 0.00 175.17 175.33 2dmz s ARG 120 N -3.43 3.69 0.07 4.34 3.52 -1.26 -4.77 118.95 121.11 2dmz s ARG 120 Ca 0.32 -2.64 -0.09 0.00 -0.13 0.00 0.00 55.73 53.19 2dmz s ARG 120 Cb -0.09 -4.43 0.00 0.00 -1.56 0.00 0.00 34.95 28.87 2dmz s ARG 120 CO 0.25 -1.28 0.20 0.20 -0.81 0.00 0.00 175.30 173.86 2dmz s GLY 121 N 1.90 0.06 -0.09 8.12 0.00 -1.26 -4.92 107.32 111.13 2dmz s GLY 121 Ca 0.21 -0.48 -0.03 0.00 0.00 0.00 0.00 44.72 44.41 2dmz s GLY 121 CO -0.09 -0.66 0.15 -1.08 0.00 0.00 0.00 173.10 171.42 2dmz s THR 122 N -3.37 -0.24 -0.03 0.90 -1.32 -1.26 -3.02 115.64 107.31 2dmz s THR 122 Ca 0.01 0.31 0.01 0.00 -1.21 0.00 0.00 61.69 60.81 2dmz s THR 122 Cb 0.03 -0.31 0.02 0.00 -1.51 0.00 0.00 72.50 70.72 2dmz s THR 122 CO -0.08 0.11 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.73 2dmz s VAL 123 N 2.27 0.28 0.28 5.08 1.01 -1.26 -5.03 120.40 123.04 2dmz s VAL 123 Ca 0.04 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 2dmz s VAL 123 Cb -0.12 -0.33 -0.09 0.00 0.00 0.00 0.00 36.38 35.83 2dmz s VAL 123 CO -0.06 0.15 1.01 -0.94 0.00 0.00 0.00 175.10 175.26 2dmz s SER 124 N 0.76 7.40 0.00 3.32 1.04 -1.26 -4.92 113.70 120.05 2dmz s SER 124 Ca -0.08 2.06 0.00 0.00 0.48 0.00 0.00 55.95 58.41 2dmz s SER 124 Cb -0.11 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.39 2dmz s SER 124 CO -0.01 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.79 2dmz n GLY 125 N 1.18 3.05 2.16 7.32 0.00 -1.26 -5.17 105.19 112.48 2dmz n GLY 125 Ca -0.01 0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 2dmz n GLY 125 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dmz n PRO 126 N -0.15 -2.33 -2.71 1.61 -0.04 -1.26 -5.07 135.00 125.04 2dmz n PRO 126 Ca 0.00 -1.08 -0.21 0.00 -0.04 0.00 0.00 63.50 62.17 2dmz n PRO 126 Cb 0.00 -1.01 0.06 0.00 -0.04 0.00 0.00 33.50 32.51 2dmz n PRO 126 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dmz s SER 127 N -3.32 4.99 0.03 3.54 1.04 -1.26 -5.13 113.70 113.59 2dmz s SER 127 Ca 0.44 -0.29 -0.29 0.00 0.48 0.00 0.00 55.95 56.30 2dmz s SER 127 Cb -0.04 -0.41 0.10 0.00 0.10 0.00 0.00 66.02 65.77 2dmz s SER 127 CO 0.34 -1.37 1.08 -0.94 0.98 0.00 0.00 173.24 173.33 2dmz s SER 128 N -4.55 -0.17 0.00 7.02 1.04 -1.26 -5.35 113.70 110.43 2dmz s SER 128 Ca 0.61 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2dmz s SER 128 Cb -0.08 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.37 2dmz s SER 128 CO 0.40 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.64